SCHEMBL4338917

SCHEMBL4338917

CC(C)(C)OC(=O)N1CCC[C@@H](ON)C1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.52
KMT2A Q03164 1/20 0.52
HPGD P15428 1/20 0.50
PRMT5 O14744 1/20 0.45
WDR77 Q9BQA1 1/20 0.45
EPHX1 P07099 1/20 0.44
CHEK2 O96017 1/20 0.44
PDE4B Q07343 1/20 0.44
PREP P48147 1/20 0.43
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
USP30 Q70CQ3 2/20 0.42
RECQL P46063 1/20 0.41
BACE1 P56817 2/20 0.41
CTSD P07339 1/20 0.41
NR1H2 P55055 1/20 0.41
HSD17B10 Q99714 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15342655 1.00 MEN1 (0.52) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL4275776 1.00 MEN1 (0.52) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL1920997 0.90 HPGD (0.49) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL1921000 0.90 HPGD (0.49) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL15342623 0.90 HPGD (0.49) MEN1ALDH1A1MAPTKMT2AHPGD
Hydrochloric Acid SCHEMBL4339378 0.89 HPGD (0.48) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL1771389 0.86 MEN1 (0.53) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL15696592 0.86 MEN1 (0.53) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL791930 0.86 MEN1 (0.53) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL6498946 0.85 HPGD (0.51) MEN1ALDH1A1MAPTKMT2AHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10544146-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors FEDORA PHARMACEUTICALS INC. (CA) 2020-01-28 US disclosed
US-10030019-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors FEDORA PHARMACEUTICALS INC. (CA) 2018-07-24 US disclosed
US-10030019-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors FEDORA PHARMACEUTICALS INC. (CA) 2018-07-24 US disclosed
US-9505761-B2 Bicyclic compounds and their use as antibacterial agents and beta-lactamase inhibitors FEDORA PHARMACEUTICALS INC. (CA) 2016-11-29 US disclosed
US-9505761-B2 Bicyclic compounds and their use as antibacterial agents and beta-lactamase inhibitors FEDORA PHARMACEUTICALS INC. (CA) 2016-11-29 US disclosed
US-20160297817-A1 BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND BETA-LACTAMASE INHIBITORS FEDORA PHARMACEUTICALS INC. (CA) 2016-10-13 US disclosed
US-20160297817-A1 BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND BETA-LACTAMASE INHIBITORS FEDORA PHARMACEUTICALS INC. (CA) 2016-10-13 US disclosed
US-9393239-B2 Bicyclic compounds and their use as antibacterial agents and betalactamase inhibitors FEDORA PHARMACEUTICALS INC. (CA) 2016-07-19 US disclosed
US-9393239-B2 Bicyclic compounds and their use as antibacterial agents and betalactamase inhibitors FEDORA PHARMACEUTICALS INC. (CA) 2016-07-19 US disclosed
US-8877743-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors NAEJA PHARMACEUTICAL INC. (CA) 2014-11-04 US disclosed
US-8796257-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors NAEJA PHARMACEUTICAL INC. (CA) 2014-08-05 US disclosed
US-8796257-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors NAEJA PHARMACEUTICAL INC. (CA) 2014-08-05 US disclosed
WO-2014091268-A1 NEW BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND β-LACTAMASE INHIBITORS NAEJA PHARMACEUTICAL INC. (CA) 2014-06-19 WO disclosed
US-20130281359-A1 NEW BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND BETA-LACTAMASE INHIBITORS FEDORA PHARMACEUTICALS INC. (CA) 2013-10-24 US disclosed
US-20130281359-A1 NEW BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND BETA-LACTAMASE INHIBITORS FEDORA PHARMACEUTICALS INC. (CA) 2013-10-24 US disclosed
US-8536160-B2 Azaheterocyclyl derivatives of androstanes and androstenes as medicaments for cardiovascular disorders SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2013-09-17 US disclosed
EP-2004669-B1 AZAHETEROCYCLYL DERIVATIVES OF ANDROSTANES AND ANDROSTENES AS MEDICAMENTS FOR CARDIOVASCULAR DISORDERS SIGMA TAU IND FARMACEUTI (IT) 2013-01-23 EP disclosed
US-20090275542-A1 AZAHETEROCYCLYL DERIVATIVES OF ANDROSTANES AND ANDROSTENES AS MEDICAMENTS FOR CARDIOVASCULAR DISORDERS SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2009-11-05 US disclosed
EP-2004669-A1 AZAHETEROCYCLYL DERIVATIVES OF ANDROSTANES AND ANDROSTENES AS MEDICAMENTS FOR CARDIOVASCULAR DISORDERS SIGMA-TAU Industrie Farmaceutiche Riunite S.p.A. (IT) 2008-12-24 EP disclosed
WO-2007118830-A1 AZAHETEROCYCLYL DERIVATIVES OF ANDROSTANES AND ANDROSTENES AS MEDICAMENTS FOR CARDIOVASCULAR DISORDERS SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2007-10-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160297817-A1 BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND BETA-LACTAMASE INHIBITORS NR0B1, NR0B2, NR2E1 MEN1 2361/4885ALDH1A1 1138/4885MAPT 4614/4885
US-10544146-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors NR0B1, NR2E1, NR0B2 MEN1 2440/4885ALDH1A1 1128/4885MAPT 4602/4885
US-20130281359-A1 NEW BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND BETA-LACTAMASE INHIBITORS MRPL21, MGAM, BACE1 MEN1 1403/4885ALDH1A1 398/4885MAPT 3885/4885
US-10030019-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors NR0B1, NR2E1, NR0B2 MEN1 2440/4885ALDH1A1 1128/4885MAPT 4602/4885
US-20090275542-A1 AZAHETEROCYCLYL DERIVATIVES OF ANDROSTANES AND ANDROSTENES AS MEDICAMENTS FOR CARDIOVASCULAR DISORDERS ATP1A2, ATP6V1B1, ATP1A3 MEN1 3261/4885ALDH1A1 1381/4885MAPT 4477/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.